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RDKit
Open-source cheminformatics and machine learning.
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#include <RDGeneral/export.h>#include <GraphMol/MacroAtomInfo.h>#include <GraphMol/RWMol.h>#include <GraphMol/SubstanceGroup.h>#include <map>#include <memory>#include <string>#include <utility>#include <vector>Go to the source code of this file.
Classes | |
| struct | RDKit::MacroMolLeavingGroup |
| Describes the atoms removed at one MacroMol template attachment point. More... | |
| class | RDKit::MacroMolTemplate |
| class | RDKit::MacroMolTemplateBuilder |
| Collects and validates the pieces needed to create a MacroMolTemplate. More... | |
| class | RDKit::MacroMolTemplateLibrary |
Namespaces | |
| namespace | RDKit |
| Std stuff. | |
Variables | |
| class RDKIT_GRAPHMOL_EXPORT | RDKit::MacroMolTemplateBuilder |